SCHEMBL8963978

SCHEMBL8963978

CCCCCC1CCC(C2CC=C(c3ccc(-c4ccc(-c5ccc(OCC)c(F)c5F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.30
PDE5A O76074 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8964186 0.99 RARB (0.30) NAAAPDE5AHDAC1HDAC6
SCHEMBL8964076 0.96 PPARD (0.32)
SCHEMBL8964057 0.96 CCNT1 (0.32)
SCHEMBL8964251 0.95 RARB (0.32)
SCHEMBL8964052 0.95 RARB (0.32)
SCHEMBL8964109 0.95 RARB (0.32)
SCHEMBL8964070 0.95 RARB (0.32)
SCHEMBL8964207 0.95 CCNT1 (0.32)
SCHEMBL8964257 0.95 RARB (0.32)
SCHEMBL8963980 0.95 CCNT1 (0.30)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed